Aiswarya M Parameswaran
5PUBLICATIONS
6CO-AUTHORS
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Publications (5)
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|Feb 16, 2026
Automerization of Cyclobutadiene: Multiconfiguration Pair-Density Functional Theory Gives High Accuracy Where Unrestricted Kohn-Sham Density Functional Theory Does Not.Aiswarya M Parameswaran, Donald G Truhlar
|Jun 16, 2025
Vertical Excitation Energies of Organic Molecules Calculated by the MC23 Hybrid Meta On-Top Functional as Compared to Other Multireference Methods.Aiswarya M Parameswaran, Dayou Zhang, Donald G Truhlar
|Mar 21, 2025
Learning Multiple Potential Energy Surfaces by Automated Discovery of a Compatible Representation.Yinan Shu, Zoltan Varga, Dayou Zhang
|Dec 03, 2024
Evaluating Cost and Accuracy in Two-Point Complete Basis Set Extrapolation Schemes Using Efficient Diffuse Basis Sets.Aiswarya M Parameswaran, Antonio Fernández-Ramos, Donald G Truhlar
|Aug 06, 2024
Fitting of Coupled Potential Energy Surfaces via Discovery of Companion Matrices by Machine Intelligence.Yinan Shu, Zoltan Varga, Aiswarya M Parameswaran
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